6α,9α-Difluoro-11β,17α-dihydroxy-16α-methyl-3-oxoandrosta-1,4-diene-17β-carboxylic acid

CAS Registry Number®

28416-82-2

CAS Name

6α,9α-Difluoro-11β,17α-dihydroxy-16α-methyl-3-oxoandrosta-1,4-diene-17β-carboxylic acid

Molecular Formula

C21H26F2O5

Molecular Mass

396.42

Cite this Page

6α,9α-Difluoro-11β,17α-dihydroxy-16α-methyl-3-oxoandrosta-1,4-diene-17β-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=28416-82-2 (retrieved 2024-11-25) (CAS RN: 28416-82-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H26F2O5/c1-10-6-12-13-8-15(22)14-7-11(24)4-5-18(14,2)20(13,23)16(25)9-19(12,3)21(10,28)17(26)27/h4-5,7,10,12-13,15-16,25,28H,6,8-9H2,1-3H3,(H,26,27)/t10-,12+,13+,15+,16+,18+,19+,20+,21+/m1/s1

InChIKey

InChIKey=QSVBUQTYFQFEHC-IDIDPBNYSA-N

SMILES

C[C@@]12[C@]([C@]3([C@](F)([C@@H](O)C1)[C@]4(C)C([C@@H](F)C3)=CC(=O)C=C4)[H])(C[C@@H](C)[C@@]2(C(O)=O)O)[H]

Canonical SMILES

O=C1C=CC2(C(=C1)C(F)CC3C4CC(C)C(O)(C(=O)O)C4(C)CC(O)C32F)C

Other Names for this Substance

  • Androsta-1,4-diene-17-carboxylic acid, 6,9-difluoro-11,17-dihydroxy-16-methyl-3-oxo-, (6α,11β,16α,17α)-
  • Androsta-1,4-diene-17β-carboxylic acid, 6α,9-difluoro-11β,17-dihydroxy-16α-methyl-3-oxo-
  • (6α,11β,16α,17α)-6,9-Difluoro-11,17-dihydroxy-16-methyl-3-oxoandrosta-1,4-diene-17-carboxylic acid
  • 6α,9α-Difluoro-11β,17α-dihydroxy-16α-methylpregna-3-oxo-1,4-diene-17β-carboxylic acid
  • 6α,9α-Difluoro-11β,17α-dihydroxy-16α-methyl-3-oxoandrosta-1,4-diene-17β-carboxylic acid

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